SCHEMBL6889422

SCHEMBL6889422

CCCNC(=O)c1cc(C(N)=O)cc(C(N)=O)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.53
KMT2A Q03164 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
KDM4E B2RXH2 2/20 0.51
NAMPT P43490 1/20 0.48
POLB P06746 3/20 0.47
ALDH1A1 P00352 3/20 0.47
THRB P10828 1/20 0.44
RECQL P46063 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
BACE1 P56817 1/20 0.43
MEN1 O00255 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
ROCK2 O75116 1/20 0.43
PTGS1 P23219 1/20 0.43
PTGS2 P35354 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL18459982 0.93 L3MBTL1 (0.47) L3MBTL1KMT2ASMN1; SMN2KDM4ENAMPT
SCHEMBL20991495 0.93 L3MBTL1 (0.47) L3MBTL1KMT2ASMN1; SMN2KDM4ENAMPT
SCHEMBL6437787 0.90 L3MBTL1 (0.61) L3MBTL1KMT2ASMN1; SMN2KDM4EPOLB
SCHEMBL2588584 0.89 SMN1; SMN2 (0.67) L3MBTL1KMT2ASMN1; SMN2MEN1PTGS1
SCHEMBL10863404 0.86 NAAA (0.61) L3MBTL1KMT2ASMN1; SMN2ALDH1A1THRB
SCHEMBL6536714 0.86 NAAA (0.61) L3MBTL1KMT2ASMN1; SMN2ALDH1A1THRB
SCHEMBL2964483 0.86 L3MBTL1 (0.69) L3MBTL1KMT2ASMN1; SMN2KDM4ENAMPT
SCHEMBL2977016 0.85 KDM4E (0.65) L3MBTL1KMT2AKDM4ENAMPTPOLB
SCHEMBL15835231 0.84 L3MBTL1 (0.56) L3MBTL1KMT2ASMN1; SMN2KDM4EPOLB
SCHEMBL2759013 0.82 NTRK2 (0.56) L3MBTL1KMT2ASMN1; SMN2KDM4EPOLB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2004502669-A 2004-01-29 JP claimed
EP-1353898-A2 COMPOUNDS TO TREAT ALZHEIMER'S DISEASE Elan Pharmaceuticals, Inc. (US) 2003-10-22 EP claimed
WO-2002002512-A2 COMPOUNDS TO TREAT ALZHEIMER'S DISEASE ELAN PHARMACEUTICALS, INC. (US) 2002-01-10 WO claimed